Synthesis and Experimental Validation of New Designed Heterocyclic Compounds with Antiproliferative Activity versus Breast Cancer Cell Lines MCF-7 and MDA-MB-231 Article Swipe

PDF

Vincenza Barresi , Carmela Bonaccorso , Domenico A. Cristaldi , Maria Modica , Nicolò Musso , Valeria Pittalà , Loredana Salerno , Cosimo G. Fortuna ·

YOU? · · 2017 · Open Access · · DOI: https://doi.org/10.1155/2017/9729284

Recent drug discovery efforts are highly focused towards identification, design, and synthesis of small molecules as anticancer agents. With this aim, we recently designed and synthesized novel compounds with high efficacy and specificity for the treatment of breast tumors. Based on the obtained results, we constructed a Volsurf+ (VS+) model using a dataset of 59 compounds able to predict the in vitro antitumor activity against MCF-7 cancer cell line for new derivatives. In the present paper, in order to further verify the robustness of this model, we report the results of the projection of more than 150 known molecules and 9 newly synthesized compounds. We predict their activity versus MCF-7 cell line and experimentally verify the in silico results for some promising chosen molecules in two human breast cell lines, MCF-7 and MDA-MB-231.

Related Topics

Computational Biology

Concepts

MCF-7 Chemistry In silico Cell culture Cancer cell lines In vitro Breast cancer Human breast Combinatorial chemistry Cancer research Cancer cell Computational biology Cancer Biochemistry Internal medicine Biology Gene Genetics Medicine

Metadata

Type: article
Language: en
Landing Page: https://doi.org/10.1155/2017/9729284
PDF: http://downloads.hindawi.com/journals/jchem/2017/9729284.pdf
OA Status: gold
Cited By: 5
References: 39
Related Works: 10
OpenAlex ID: https://openalex.org/W2601759472

All OpenAlex metadata

Raw OpenAlex JSON

OpenAlex ID: https://openalex.org/W2601759472

Canonical identifier for this work in OpenAlex
DOI: https://doi.org/10.1155/2017/9729284

Digital Object Identifier
Title: Synthesis and Experimental Validation of New Designed Heterocyclic Compounds with Antiproliferative Activity versus Breast Cancer Cell Lines MCF-7 and MDA-MB-231

Work title
Type: article

OpenAlex work type
Language: en

Primary language
Publication year: 2017

Year of publication
Publication date: 2017-01-01

Full publication date if available
Authors: Vincenza Barresi, Carmela Bonaccorso, Domenico A. Cristaldi, Maria Modica, Nicolò Musso, Valeria Pittalà, Loredana Salerno, Cosimo G. Fortuna

List of authors in order
Landing page: https://doi.org/10.1155/2017/9729284

Publisher landing page
PDF URL: https://downloads.hindawi.com/journals/jchem/2017/9729284.pdf

Direct link to full text PDF
Open access: Yes

Whether a free full text is available
OA status: gold

Open access status per OpenAlex
OA URL: https://downloads.hindawi.com/journals/jchem/2017/9729284.pdf

Direct OA link when available
Concepts: MCF-7, Chemistry, In silico, Cell culture, Cancer cell lines, In vitro, Breast cancer, Human breast, Combinatorial chemistry, Cancer research, Cancer cell, Computational biology, Cancer, Biochemistry, Internal medicine, Biology, Gene, Genetics, Medicine

Top concepts (fields/topics) attached by OpenAlex
Cited by: 5

Total citation count in OpenAlex
Citations by year (recent): 2023: 1, 2022: 2, 2020: 2

Per-year citation counts (last 5 years)
References (count): 39

Number of works referenced by this work
Related works (count): 10

Other works algorithmically related by OpenAlex

Full payload

id	https://openalex.org/W2601759472
doi	https://doi.org/10.1155/2017/9729284
ids.doi	https://doi.org/10.1155/2017/9729284
ids.mag	2601759472
ids.openalex	https://openalex.org/W2601759472
fwci	0.59185335
type	article
title	Synthesis and Experimental Validation of New Designed Heterocyclic Compounds with Antiproliferative Activity versus Breast Cancer Cell Lines MCF-7 and MDA-MB-231
biblio.issue
biblio.volume	2017
biblio.last_page	10
biblio.first_page	1
grants[0].funder	https://openalex.org/F4320322690
grants[0].award_id
grants[0].funder_display_name	Università di Catania
topics[0].id	https://openalex.org/T10211
topics[0].field.id	https://openalex.org/fields/17
topics[0].field.display_name	Computer Science
topics[0].score	0.9993000030517578
topics[0].domain.id	https://openalex.org/domains/3
topics[0].domain.display_name	Physical Sciences
topics[0].subfield.id	https://openalex.org/subfields/1703
topics[0].subfield.display_name	Computational Theory and Mathematics
topics[0].display_name	Computational Drug Discovery Methods
topics[1].id	https://openalex.org/T11440
topics[1].field.id	https://openalex.org/fields/16
topics[1].field.display_name	Chemistry
topics[1].score	0.9919999837875366
topics[1].domain.id	https://openalex.org/domains/3
topics[1].domain.display_name	Physical Sciences
topics[1].subfield.id	https://openalex.org/subfields/1605
topics[1].subfield.display_name	Organic Chemistry
topics[1].display_name	Click Chemistry and Applications
topics[2].id	https://openalex.org/T10911
topics[2].field.id	https://openalex.org/fields/13
topics[2].field.display_name	Biochemistry, Genetics and Molecular Biology
topics[2].score	0.9819999933242798
topics[2].domain.id	https://openalex.org/domains/1
topics[2].domain.display_name	Life Sciences
topics[2].subfield.id	https://openalex.org/subfields/1312
topics[2].subfield.display_name	Molecular Biology
topics[2].display_name	Chemical Synthesis and Analysis
funders[0].id	https://openalex.org/F4320322690
funders[0].ror	https://ror.org/03a64bh57
funders[0].display_name	Università di Catania
is_xpac	False
apc_list.value	1650
apc_list.currency	USD
apc_list.value_usd	1650
apc_paid.value	1650
apc_paid.currency	USD
apc_paid.value_usd	1650
concepts[0].id	https://openalex.org/C109541995
concepts[0].level	5
concepts[0].score	0.9435105919837952
concepts[0].wikidata	https://www.wikidata.org/wiki/Q1881253
concepts[0].display_name	MCF-7
concepts[1].id	https://openalex.org/C185592680
concepts[1].level	0
concepts[1].score	0.8740471601486206
concepts[1].wikidata	https://www.wikidata.org/wiki/Q2329
concepts[1].display_name	Chemistry
concepts[2].id	https://openalex.org/C2775905019
concepts[2].level	3
concepts[2].score	0.7971900701522827
concepts[2].wikidata	https://www.wikidata.org/wiki/Q192572
concepts[2].display_name	In silico
concepts[3].id	https://openalex.org/C81885089
concepts[3].level	2
concepts[3].score	0.5977039337158203
concepts[3].wikidata	https://www.wikidata.org/wiki/Q189082
concepts[3].display_name	Cell culture
concepts[4].id	https://openalex.org/C2994372470
concepts[4].level	4
concepts[4].score	0.5906214714050293
concepts[4].wikidata	https://www.wikidata.org/wiki/Q4118072
concepts[4].display_name	Cancer cell lines
concepts[5].id	https://openalex.org/C202751555
concepts[5].level	2
concepts[5].score	0.5897400975227356
concepts[5].wikidata	https://www.wikidata.org/wiki/Q221681
concepts[5].display_name	In vitro
concepts[6].id	https://openalex.org/C530470458
concepts[6].level	3
concepts[6].score	0.5781130194664001
concepts[6].wikidata	https://www.wikidata.org/wiki/Q128581
concepts[6].display_name	Breast cancer
concepts[7].id	https://openalex.org/C2994423619
concepts[7].level	4
concepts[7].score	0.4956308603286743
concepts[7].wikidata	https://www.wikidata.org/wiki/Q9103
concepts[7].display_name	Human breast
concepts[8].id	https://openalex.org/C21951064
concepts[8].level	1
concepts[8].score	0.43011486530303955
concepts[8].wikidata	https://www.wikidata.org/wiki/Q899212
concepts[8].display_name	Combinatorial chemistry
concepts[9].id	https://openalex.org/C502942594
concepts[9].level	1
concepts[9].score	0.42121490836143494
concepts[9].wikidata	https://www.wikidata.org/wiki/Q3421914
concepts[9].display_name	Cancer research
concepts[10].id	https://openalex.org/C96232424
concepts[10].level	3
concepts[10].score	0.41398513317108154
concepts[10].wikidata	https://www.wikidata.org/wiki/Q4118072
concepts[10].display_name	Cancer cell
concepts[11].id	https://openalex.org/C70721500
concepts[11].level	1
concepts[11].score	0.41072165966033936
concepts[11].wikidata	https://www.wikidata.org/wiki/Q177005
concepts[11].display_name	Computational biology
concepts[12].id	https://openalex.org/C121608353
concepts[12].level	2
concepts[12].score	0.3358767330646515
concepts[12].wikidata	https://www.wikidata.org/wiki/Q12078
concepts[12].display_name	Cancer
concepts[13].id	https://openalex.org/C55493867
concepts[13].level	1
concepts[13].score	0.26793068647384644
concepts[13].wikidata	https://www.wikidata.org/wiki/Q7094
concepts[13].display_name	Biochemistry
concepts[14].id	https://openalex.org/C126322002
concepts[14].level	1
concepts[14].score	0.09318152070045471
concepts[14].wikidata	https://www.wikidata.org/wiki/Q11180
concepts[14].display_name	Internal medicine
concepts[15].id	https://openalex.org/C86803240
concepts[15].level	0
concepts[15].score	0.0
concepts[15].wikidata	https://www.wikidata.org/wiki/Q420
concepts[15].display_name	Biology
concepts[16].id	https://openalex.org/C104317684
concepts[16].level	2
concepts[16].score	0.0
concepts[16].wikidata	https://www.wikidata.org/wiki/Q7187
concepts[16].display_name	Gene
concepts[17].id	https://openalex.org/C54355233
concepts[17].level	1
concepts[17].score	0.0
concepts[17].wikidata	https://www.wikidata.org/wiki/Q7162
concepts[17].display_name	Genetics
concepts[18].id	https://openalex.org/C71924100
concepts[18].level	0
concepts[18].score	0.0
concepts[18].wikidata	https://www.wikidata.org/wiki/Q11190
concepts[18].display_name	Medicine
keywords[0].id	https://openalex.org/keywords/mcf-7
keywords[0].score	0.9435105919837952
keywords[0].display_name	MCF-7
keywords[1].id	https://openalex.org/keywords/chemistry
keywords[1].score	0.8740471601486206
keywords[1].display_name	Chemistry
keywords[2].id	https://openalex.org/keywords/in-silico
keywords[2].score	0.7971900701522827
keywords[2].display_name	In silico
keywords[3].id	https://openalex.org/keywords/cell-culture
keywords[3].score	0.5977039337158203
keywords[3].display_name	Cell culture
keywords[4].id	https://openalex.org/keywords/cancer-cell-lines
keywords[4].score	0.5906214714050293
keywords[4].display_name	Cancer cell lines
keywords[5].id	https://openalex.org/keywords/in-vitro
keywords[5].score	0.5897400975227356
keywords[5].display_name	In vitro
keywords[6].id	https://openalex.org/keywords/breast-cancer
keywords[6].score	0.5781130194664001
keywords[6].display_name	Breast cancer
keywords[7].id	https://openalex.org/keywords/human-breast
keywords[7].score	0.4956308603286743
keywords[7].display_name	Human breast
keywords[8].id	https://openalex.org/keywords/combinatorial-chemistry
keywords[8].score	0.43011486530303955
keywords[8].display_name	Combinatorial chemistry
keywords[9].id	https://openalex.org/keywords/cancer-research
keywords[9].score	0.42121490836143494
keywords[9].display_name	Cancer research
keywords[10].id	https://openalex.org/keywords/cancer-cell
keywords[10].score	0.41398513317108154
keywords[10].display_name	Cancer cell
keywords[11].id	https://openalex.org/keywords/computational-biology
keywords[11].score	0.41072165966033936
keywords[11].display_name	Computational biology
keywords[12].id	https://openalex.org/keywords/cancer
keywords[12].score	0.3358767330646515
keywords[12].display_name	Cancer
keywords[13].id	https://openalex.org/keywords/biochemistry
keywords[13].score	0.26793068647384644
keywords[13].display_name	Biochemistry
keywords[14].id	https://openalex.org/keywords/internal-medicine
keywords[14].score	0.09318152070045471
keywords[14].display_name	Internal medicine
language	en
locations[0].id	doi:10.1155/2017/9729284
locations[0].is_oa	True
locations[0].source.id	https://openalex.org/S2482584171
locations[0].source.issn	2090-9063, 2090-9071
locations[0].source.type	journal
locations[0].source.is_oa	True
locations[0].source.issn_l	2090-9063
locations[0].source.is_core	True
locations[0].source.is_in_doaj	True
locations[0].source.display_name	Journal of Chemistry
locations[0].source.host_organization	https://openalex.org/P4310319869
locations[0].source.host_organization_name	Hindawi Publishing Corporation
locations[0].source.host_organization_lineage	https://openalex.org/P4310319869
locations[0].license	cc-by
locations[0].pdf_url	http://downloads.hindawi.com/journals/jchem/2017/9729284.pdf
locations[0].version	publishedVersion
locations[0].raw_type	journal-article
locations[0].license_id	https://openalex.org/licenses/cc-by
locations[0].is_accepted	True
locations[0].is_published	True
locations[0].raw_source_name	Journal of Chemistry
locations[0].landing_page_url	https://doi.org/10.1155/2017/9729284
locations[1].id	pmh:oai:doaj.org/article:f710bcb8e9fb4c159cdaf77ef3796c2d
locations[1].is_oa	False
locations[1].source.id	https://openalex.org/S4306401280
locations[1].source.issn
locations[1].source.type	repository
locations[1].source.is_oa	False
locations[1].source.issn_l
locations[1].source.is_core	False
locations[1].source.is_in_doaj	False
locations[1].source.display_name	DOAJ (DOAJ: Directory of Open Access Journals)
locations[1].source.host_organization
locations[1].source.host_organization_name
locations[1].source.host_organization_lineage
locations[1].license
locations[1].pdf_url
locations[1].version	submittedVersion
locations[1].raw_type	article
locations[1].license_id
locations[1].is_accepted	False
locations[1].is_published	False
locations[1].raw_source_name	Journal of Chemistry, Vol 2017 (2017)
locations[1].landing_page_url	https://doaj.org/article/f710bcb8e9fb4c159cdaf77ef3796c2d
indexed_in	crossref, doaj
authorships[0].author.id	https://openalex.org/A5034663405
authorships[0].author.orcid	https://orcid.org/0000-0003-1183-6981
authorships[0].author.display_name	Vincenza Barresi
authorships[0].countries	IT
authorships[0].affiliations[0].institution_ids	https://openalex.org/I39063666
authorships[0].affiliations[0].raw_affiliation_string	Department of Biomedical and Biotechnological Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[0].institutions[0].id	https://openalex.org/I39063666
authorships[0].institutions[0].ror	https://ror.org/03a64bh57
authorships[0].institutions[0].type	education
authorships[0].institutions[0].lineage	https://openalex.org/I39063666
authorships[0].institutions[0].country_code	IT
authorships[0].institutions[0].display_name	University of Catania
authorships[0].author_position	first
authorships[0].raw_author_name	Vincenza Barresi
authorships[0].is_corresponding	False
authorships[0].raw_affiliation_strings	Department of Biomedical and Biotechnological Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[1].author.id	https://openalex.org/A5049029302
authorships[1].author.orcid	https://orcid.org/0000-0001-9112-5623
authorships[1].author.display_name	Carmela Bonaccorso
authorships[1].countries	IT
authorships[1].affiliations[0].institution_ids	https://openalex.org/I39063666
authorships[1].affiliations[0].raw_affiliation_string	Department of Chemical Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[1].institutions[0].id	https://openalex.org/I39063666
authorships[1].institutions[0].ror	https://ror.org/03a64bh57
authorships[1].institutions[0].type	education
authorships[1].institutions[0].lineage	https://openalex.org/I39063666
authorships[1].institutions[0].country_code	IT
authorships[1].institutions[0].display_name	University of Catania
authorships[1].author_position	middle
authorships[1].raw_author_name	Carmela Bonaccorso
authorships[1].is_corresponding	False
authorships[1].raw_affiliation_strings	Department of Chemical Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[2].author.id	https://openalex.org/A5008361121
authorships[2].author.orcid	https://orcid.org/0000-0002-8279-1496
authorships[2].author.display_name	Domenico A. Cristaldi
authorships[2].countries	IT
authorships[2].affiliations[0].institution_ids	https://openalex.org/I39063666
authorships[2].affiliations[0].raw_affiliation_string	Department of Chemical Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[2].institutions[0].id	https://openalex.org/I39063666
authorships[2].institutions[0].ror	https://ror.org/03a64bh57
authorships[2].institutions[0].type	education
authorships[2].institutions[0].lineage	https://openalex.org/I39063666
authorships[2].institutions[0].country_code	IT
authorships[2].institutions[0].display_name	University of Catania
authorships[2].author_position	middle
authorships[2].raw_author_name	Domenico A. Cristaldi
authorships[2].is_corresponding	False
authorships[2].raw_affiliation_strings	Department of Chemical Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[3].author.id	https://openalex.org/A5056771219
authorships[3].author.orcid	https://orcid.org/0000-0002-6350-931X
authorships[3].author.display_name	Maria Modica
authorships[3].countries	IT
authorships[3].affiliations[0].institution_ids	https://openalex.org/I39063666
authorships[3].affiliations[0].raw_affiliation_string	Department of Drug Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[3].institutions[0].id	https://openalex.org/I39063666
authorships[3].institutions[0].ror	https://ror.org/03a64bh57
authorships[3].institutions[0].type	education
authorships[3].institutions[0].lineage	https://openalex.org/I39063666
authorships[3].institutions[0].country_code	IT
authorships[3].institutions[0].display_name	University of Catania
authorships[3].author_position	middle
authorships[3].raw_author_name	Maria N. Modica
authorships[3].is_corresponding	False
authorships[3].raw_affiliation_strings	Department of Drug Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[4].author.id	https://openalex.org/A5063488684
authorships[4].author.orcid	https://orcid.org/0000-0003-2451-1158
authorships[4].author.display_name	Nicolò Musso
authorships[4].countries	IT
authorships[4].affiliations[0].institution_ids	https://openalex.org/I39063666
authorships[4].affiliations[0].raw_affiliation_string	Department of Biomedical and Biotechnological Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[4].institutions[0].id	https://openalex.org/I39063666
authorships[4].institutions[0].ror	https://ror.org/03a64bh57
authorships[4].institutions[0].type	education
authorships[4].institutions[0].lineage	https://openalex.org/I39063666
authorships[4].institutions[0].country_code	IT
authorships[4].institutions[0].display_name	University of Catania
authorships[4].author_position	middle
authorships[4].raw_author_name	Nicolò Musso
authorships[4].is_corresponding	False
authorships[4].raw_affiliation_strings	Department of Biomedical and Biotechnological Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[5].author.id	https://openalex.org/A5066691562
authorships[5].author.orcid	https://orcid.org/0000-0003-1856-0308
authorships[5].author.display_name	Valeria Pittalà
authorships[5].countries	IT
authorships[5].affiliations[0].institution_ids	https://openalex.org/I39063666
authorships[5].affiliations[0].raw_affiliation_string	Department of Drug Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[5].institutions[0].id	https://openalex.org/I39063666
authorships[5].institutions[0].ror	https://ror.org/03a64bh57
authorships[5].institutions[0].type	education
authorships[5].institutions[0].lineage	https://openalex.org/I39063666
authorships[5].institutions[0].country_code	IT
authorships[5].institutions[0].display_name	University of Catania
authorships[5].author_position	middle
authorships[5].raw_author_name	Valeria Pittalà
authorships[5].is_corresponding	True
authorships[5].raw_affiliation_strings	Department of Drug Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[6].author.id	https://openalex.org/A5084855762
authorships[6].author.orcid	https://orcid.org/0000-0001-6458-3717
authorships[6].author.display_name	Loredana Salerno
authorships[6].countries	IT
authorships[6].affiliations[0].institution_ids	https://openalex.org/I39063666
authorships[6].affiliations[0].raw_affiliation_string	Department of Drug Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[6].institutions[0].id	https://openalex.org/I39063666
authorships[6].institutions[0].ror	https://ror.org/03a64bh57
authorships[6].institutions[0].type	education
authorships[6].institutions[0].lineage	https://openalex.org/I39063666
authorships[6].institutions[0].country_code	IT
authorships[6].institutions[0].display_name	University of Catania
authorships[6].author_position	middle
authorships[6].raw_author_name	Loredana Salerno
authorships[6].is_corresponding	False
authorships[6].raw_affiliation_strings	Department of Drug Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[7].author.id	https://openalex.org/A5073358726
authorships[7].author.orcid	https://orcid.org/0000-0003-1889-886X
authorships[7].author.display_name	Cosimo G. Fortuna
authorships[7].countries	IT
authorships[7].affiliations[0].institution_ids	https://openalex.org/I39063666
authorships[7].affiliations[0].raw_affiliation_string	Department of Chemical Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
authorships[7].institutions[0].id	https://openalex.org/I39063666
authorships[7].institutions[0].ror	https://ror.org/03a64bh57
authorships[7].institutions[0].type	education
authorships[7].institutions[0].lineage	https://openalex.org/I39063666
authorships[7].institutions[0].country_code	IT
authorships[7].institutions[0].display_name	University of Catania
authorships[7].author_position	last
authorships[7].raw_author_name	Cosimo G. Fortuna
authorships[7].is_corresponding	False
authorships[7].raw_affiliation_strings	Department of Chemical Sciences, University of Catania, Viale A. Doria 6, 95125 Catania, Italy
has_content.pdf	True
has_content.grobid_xml	True
is_paratext	False
open_access.is_oa	True
open_access.oa_url	http://downloads.hindawi.com/journals/jchem/2017/9729284.pdf
open_access.oa_status	gold
open_access.any_repository_has_fulltext	False
created_date	2025-10-10T00:00:00
display_name	Synthesis and Experimental Validation of New Designed Heterocyclic Compounds with Antiproliferative Activity versus Breast Cancer Cell Lines MCF-7 and MDA-MB-231
has_fulltext	True
is_retracted	False
updated_date	2025-11-06T03:46:38.306776
primary_topic.id	https://openalex.org/T10211
primary_topic.field.id	https://openalex.org/fields/17
primary_topic.field.display_name	Computer Science
primary_topic.score	0.9993000030517578
primary_topic.domain.id	https://openalex.org/domains/3
primary_topic.domain.display_name	Physical Sciences
primary_topic.subfield.id	https://openalex.org/subfields/1703
primary_topic.subfield.display_name	Computational Theory and Mathematics
primary_topic.display_name	Computational Drug Discovery Methods
related_works	https://openalex.org/W4405140203, https://openalex.org/W1991532252, https://openalex.org/W1982752578, https://openalex.org/W2811245751, https://openalex.org/W3135859027, https://openalex.org/W4313023892, https://openalex.org/W2090208884, https://openalex.org/W4233720714, https://openalex.org/W4309600429, https://openalex.org/W3048241349
cited_by_count	5
counts_by_year[0].year	2023
counts_by_year[0].cited_by_count	1
counts_by_year[1].year	2022
counts_by_year[1].cited_by_count	2
counts_by_year[2].year	2020
counts_by_year[2].cited_by_count	2
locations_count	2
best_oa_location.id	doi:10.1155/2017/9729284
best_oa_location.is_oa	True
best_oa_location.source.id	https://openalex.org/S2482584171
best_oa_location.source.issn	2090-9063, 2090-9071
best_oa_location.source.type	journal
best_oa_location.source.is_oa	True
best_oa_location.source.issn_l	2090-9063
best_oa_location.source.is_core	True
best_oa_location.source.is_in_doaj	True
best_oa_location.source.display_name	Journal of Chemistry
best_oa_location.source.host_organization	https://openalex.org/P4310319869
best_oa_location.source.host_organization_name	Hindawi Publishing Corporation
best_oa_location.source.host_organization_lineage	https://openalex.org/P4310319869
best_oa_location.license	cc-by
best_oa_location.pdf_url	http://downloads.hindawi.com/journals/jchem/2017/9729284.pdf
best_oa_location.version	publishedVersion
best_oa_location.raw_type	journal-article
best_oa_location.license_id	https://openalex.org/licenses/cc-by
best_oa_location.is_accepted	True
best_oa_location.is_published	True
best_oa_location.raw_source_name	Journal of Chemistry
best_oa_location.landing_page_url	https://doi.org/10.1155/2017/9729284
primary_location.id	doi:10.1155/2017/9729284
primary_location.is_oa	True
primary_location.source.id	https://openalex.org/S2482584171
primary_location.source.issn	2090-9063, 2090-9071
primary_location.source.type	journal
primary_location.source.is_oa	True
primary_location.source.issn_l	2090-9063
primary_location.source.is_core	True
primary_location.source.is_in_doaj	True
primary_location.source.display_name	Journal of Chemistry
primary_location.source.host_organization	https://openalex.org/P4310319869
primary_location.source.host_organization_name	Hindawi Publishing Corporation
primary_location.source.host_organization_lineage	https://openalex.org/P4310319869
primary_location.license	cc-by
primary_location.pdf_url	http://downloads.hindawi.com/journals/jchem/2017/9729284.pdf
primary_location.version	publishedVersion
primary_location.raw_type	journal-article
primary_location.license_id	https://openalex.org/licenses/cc-by
primary_location.is_accepted	True
primary_location.is_published	True
primary_location.raw_source_name	Journal of Chemistry
primary_location.landing_page_url	https://doi.org/10.1155/2017/9729284
publication_date	2017-01-01
publication_year	2017
referenced_works	https://openalex.org/W2170552969, https://openalex.org/W2123429348, https://openalex.org/W2080633639, https://openalex.org/W1635514373, https://openalex.org/W2040246440, https://openalex.org/W1989918470, https://openalex.org/W2139927762, https://openalex.org/W2056320914, https://openalex.org/W2062941476, https://openalex.org/W2162106505, https://openalex.org/W1995037393, https://openalex.org/W2053297699, https://openalex.org/W2077733632, https://openalex.org/W1974412827, https://openalex.org/W2006176759, https://openalex.org/W2004507156, https://openalex.org/W2507541707, https://openalex.org/W2150432345, https://openalex.org/W2176986126, https://openalex.org/W2174138624, https://openalex.org/W2080044289, https://openalex.org/W2051765074, https://openalex.org/W2072498673, https://openalex.org/W1974988089, https://openalex.org/W2113963357, https://openalex.org/W2007012742, https://openalex.org/W2315729491, https://openalex.org/W2059664977, https://openalex.org/W2092227974, https://openalex.org/W2091758060, https://openalex.org/W2000388507, https://openalex.org/W2478269152, https://openalex.org/W2221625877, https://openalex.org/W2043440279, https://openalex.org/W2525485911, https://openalex.org/W2311960695, https://openalex.org/W2114918609, https://openalex.org/W2018843280, https://openalex.org/W2411915705
referenced_works_count	39
abstract_inverted_index.9	100
abstract_inverted_index.a	46, 51
abstract_inverted_index.59	54
abstract_inverted_index.In	72
abstract_inverted_index.We	104
abstract_inverted_index.as	15
abstract_inverted_index.in	60, 76, 116, 124
abstract_inverted_index.of	12, 36, 53, 83, 90, 93
abstract_inverted_index.on	40
abstract_inverted_index.to	57, 78
abstract_inverted_index.we	21, 44, 86
abstract_inverted_index.150	96
abstract_inverted_index.and	10, 24, 31, 99, 112, 131
abstract_inverted_index.are	4
abstract_inverted_index.for	33, 69, 119
abstract_inverted_index.new	70
abstract_inverted_index.the	34, 41, 59, 73, 81, 88, 91, 115
abstract_inverted_index.two	125
abstract_inverted_index.With	18
abstract_inverted_index.able	56
abstract_inverted_index.aim,	20
abstract_inverted_index.cell	67, 110, 128
abstract_inverted_index.drug	1
abstract_inverted_index.high	29
abstract_inverted_index.line	68, 111
abstract_inverted_index.more	94
abstract_inverted_index.some	120
abstract_inverted_index.than	95
abstract_inverted_index.this	19, 84
abstract_inverted_index.with	28
abstract_inverted_index.(VS+)	48
abstract_inverted_index.Based	39
abstract_inverted_index.MCF-7	65, 109, 130
abstract_inverted_index.human	126
abstract_inverted_index.known	97
abstract_inverted_index.model	49
abstract_inverted_index.newly	101
abstract_inverted_index.novel	26
abstract_inverted_index.order	77
abstract_inverted_index.small	13
abstract_inverted_index.their	106
abstract_inverted_index.using	50
abstract_inverted_index.vitro	61
abstract_inverted_index.Recent	0
abstract_inverted_index.breast	37, 127
abstract_inverted_index.cancer	66
abstract_inverted_index.chosen	122
abstract_inverted_index.highly	5
abstract_inverted_index.lines,	129
abstract_inverted_index.model,	85
abstract_inverted_index.paper,	75
abstract_inverted_index.report	87
abstract_inverted_index.silico	117
abstract_inverted_index.verify	80, 114
abstract_inverted_index.versus	108
abstract_inverted_index.against	64
abstract_inverted_index.agents.	17
abstract_inverted_index.dataset	52
abstract_inverted_index.design,	9
abstract_inverted_index.efforts	3
abstract_inverted_index.focused	6
abstract_inverted_index.further	79
abstract_inverted_index.predict	58, 105
abstract_inverted_index.present	74
abstract_inverted_index.results	89, 118
abstract_inverted_index.towards	7
abstract_inverted_index.tumors.	38
abstract_inverted_index.Volsurf+	47
abstract_inverted_index.activity	63, 107
abstract_inverted_index.designed	23
abstract_inverted_index.efficacy	30
abstract_inverted_index.obtained	42
abstract_inverted_index.recently	22
abstract_inverted_index.results,	43
abstract_inverted_index.antitumor	62
abstract_inverted_index.compounds	27, 55
abstract_inverted_index.discovery	2
abstract_inverted_index.molecules	14, 98, 123
abstract_inverted_index.promising	121
abstract_inverted_index.synthesis	11
abstract_inverted_index.treatment	35
abstract_inverted_index.anticancer	16
abstract_inverted_index.compounds.	103
abstract_inverted_index.projection	92
abstract_inverted_index.robustness	82
abstract_inverted_index.MDA-MB-231.	132
abstract_inverted_index.constructed	45
abstract_inverted_index.specificity	32
abstract_inverted_index.synthesized	25, 102
abstract_inverted_index.derivatives.	71
abstract_inverted_index.experimentally	113
abstract_inverted_index.identification,	8
cited_by_percentile_year.max	96
cited_by_percentile_year.min	89
corresponding_author_ids	https://openalex.org/A5066691562
countries_distinct_count	1
institutions_distinct_count	8
corresponding_institution_ids	https://openalex.org/I39063666
sustainable_development_goals[0].id	https://metadata.un.org/sdg/3
sustainable_development_goals[0].score	0.8399999737739563
sustainable_development_goals[0].display_name	Good health and well-being
citation_normalized_percentile.value	0.64640927
citation_normalized_percentile.is_in_top_1_percent	False
citation_normalized_percentile.is_in_top_10_percent	False